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Search term: IOOBCJICSNTUDK-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-(2-Chloro-6-methylphenyl)-2-(4-pyrimidinylamino)-1,3-benzothiazole-6-carboxamide | C19H14ClN5OS

N-(2-Chloro-6-methylphenyl)-2-(4-pyrimidinylamino)-1,3-benzothiazole-6-carboxamide

  • Molecular FormulaC19H14ClN5OS
  • Average mass395.865 Da
  • Monoisotopic mass395.060760 Da
  • ChemSpider ID23176242

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

6-Benzothiazolecarboxamide, N-(2-chloro-6-methylphenyl)-2-(4-pyrimidinylamino)- [ACD/Index Name]
N-(2-Chlor-6-methylphenyl)-2-(4-pyrimidinylamino)-1,3-benzothiazol-6-carboxamid [German] [ACD/IUPAC Name]
N-(2-Chloro-6-methylphenyl)-2-(4-pyrimidinylamino)-1,3-benzothiazole-6-carboxamide [ACD/IUPAC Name]
N-(2-Chloro-6-méthylphényl)-2-(4-pyrimidinylamino)-1,3-benzothiazole-6-carboxamide [French] [ACD/IUPAC Name]
N-(2-chloro-6-methylphenyl)-2-(pyrimidin-4-ylamino)-1,3-benzothiazole-6-carboxamide
2-(Pyrimidin-4-ylamino)-benzothiazole-6-carboxylic acid (2-chloro-6-methyl-phenyl)-amide
CHEMBL408849
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL408849/

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.770
Molar Refractivity: 110.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.30
ACD/LogD (pH 5.5): 4.05
ACD/BCF (pH 5.5): 697.61
ACD/KOC (pH 5.5): 3772.59
ACD/LogD (pH 7.4): 4.05
ACD/BCF (pH 7.4): 699.93
ACD/KOC (pH 7.4): 3785.13
Polar Surface Area: 108 Å2
Polarizability: 43.8±0.5 10-24cm3
Surface Tension: 75.3±3.0 dyne/cm
Molar Volume: 265.8±3.0 cm3

Click to predict properties on the Chemicalize site


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